#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fex s ARG 3 N 0.00 1.17 -0.09 -2.82 0.52 -1.26 -1.29 118.95 115.18 2fex s ARG 3 Ca 0.00 -0.47 0.02 0.00 -0.52 0.00 0.00 55.73 54.76 2fex s ARG 3 Cb 0.00 -1.10 0.01 0.00 0.52 0.00 0.00 34.95 34.38 2fex s ARG 3 CO 0.00 0.26 -0.15 0.42 0.02 0.00 0.00 175.30 175.85 2fex s ILE 4 N -0.19 1.43 -0.03 1.52 1.01 -0.04 -0.24 121.20 124.66 2fex s ILE 4 Ca 0.03 -0.62 -0.23 0.00 0.00 0.00 0.00 60.65 59.83 2fex s ILE 4 Cb -0.07 -1.30 -0.04 0.00 0.01 0.00 0.00 42.46 41.06 2fex s ILE 4 CO -0.00 0.42 0.68 0.00 0.00 0.00 0.00 174.94 176.04 2fex s ALA 5 N 0.82 3.38 -0.23 9.38 0.00 -0.02 -1.11 121.76 133.98 2fex s ALA 5 Ca -0.11 0.12 -0.03 0.00 0.00 0.00 0.00 51.96 51.95 2fex s ALA 5 Cb -0.16 -2.90 0.01 0.00 0.00 0.00 0.00 23.12 20.07 2fex s ALA 5 CO 0.01 0.00 -0.06 0.42 0.00 0.00 0.00 175.76 176.13 2fex s ILE 6 N 0.38 3.08 -0.87 0.00 1.01 0.19 -0.30 121.20 124.68 2fex s ILE 6 Ca 0.36 -0.73 -0.17 0.00 0.00 0.00 0.00 60.65 60.11 2fex s ILE 6 Cb -0.18 -2.45 0.16 0.00 0.01 0.00 0.00 42.46 40.00 2fex s ILE 6 CO 0.19 0.35 0.97 0.00 0.00 0.00 0.00 174.94 176.44 2fex s ALA 7 N 1.41 3.65 0.90 9.38 0.00 -0.25 -1.19 121.76 135.66 2fex s ALA 7 Ca 0.04 -2.96 -0.12 0.00 0.00 0.00 0.00 51.96 48.92 2fex s ALA 7 Cb -0.15 -3.82 0.13 0.00 0.00 0.00 0.00 23.12 19.28 2fex s ALA 7 CO -0.05 -2.68 1.10 -0.51 0.00 0.00 0.00 175.76 173.62 2fex s LEU 8 N 1.69 2.16 0.24 0.00 1.43 0.62 -4.10 118.68 120.71 2fex s LEU 8 Ca 0.26 1.34 -0.15 0.00 -1.03 0.00 0.00 54.13 54.55 2fex s LEU 8 Cb -0.08 -3.74 0.01 0.00 0.03 0.00 0.00 46.19 42.41 2fex s LEU 8 CO -0.09 -2.62 0.53 0.00 0.23 0.00 0.00 176.35 174.41 2fex s ALA 9 N -3.01 -0.59 0.29 4.21 0.00 -1.26 -4.22 121.76 117.16 2fex s ALA 9 Ca 0.63 -0.62 -0.30 0.00 0.00 0.00 0.00 51.96 51.68 2fex s ALA 9 Cb -0.17 0.97 -0.13 0.00 0.00 0.00 0.00 23.12 23.79 2fex s ALA 9 CO 0.56 -0.88 1.31 1.04 0.00 0.00 0.00 175.76 177.80 2fex n GLN 10 N -0.38 1.99 -2.46 0.00 1.13 -1.26 -1.91 117.38 114.48 2fex n GLN 10 Ca -0.04 0.70 -0.17 0.00 -1.94 0.00 0.00 57.00 55.55 2fex n GLN 10 Cb 0.61 -2.29 0.00 0.00 0.11 0.00 0.00 30.24 28.67 2fex n GLN 10 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 2fex n ASP 11 N 1.48 -5.00 -4.75 1.08 8.00 0.82 -4.07 116.55 114.11 2fex n ASP 11 Ca 0.09 -0.07 -0.36 0.00 0.71 0.00 0.00 54.79 55.15 2fex n ASP 11 Cb 0.33 -4.03 0.03 0.00 -0.02 0.00 0.00 41.12 37.44 2fex n ASP 11 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2fex s PHE 12 N -2.89 2.40 -0.54 1.24 -0.12 -0.80 -1.14 117.98 116.12 2fex s PHE 12 Ca 0.07 1.51 -0.28 0.00 -0.05 0.00 0.00 56.93 58.17 2fex s PHE 12 Cb -0.03 -3.50 0.02 0.00 -0.63 0.00 0.00 43.02 38.88 2fex s PHE 12 CO 0.08 -2.25 1.26 0.00 -0.05 0.00 0.00 175.22 174.27 2fex s ALA 13 N -1.56 2.98 0.30 1.99 0.00 -0.46 -4.57 121.76 120.44 2fex s ALA 13 Ca 0.77 -0.66 0.06 0.00 0.00 0.00 0.00 51.96 52.12 2fex s ALA 13 Cb -0.31 -4.02 0.74 0.00 0.00 0.00 0.00 23.12 19.53 2fex s ALA 13 CO 0.34 -2.64 1.77 -0.44 0.00 0.00 0.00 175.76 174.79 2fex h ASP 14 N 9.99 0.78 0.82 0.00 3.45 -1.90 -1.08 116.42 128.47 2fex h ASP 14 Ca -0.25 0.10 0.00 0.00 0.43 0.00 0.00 57.03 57.31 2fex h ASP 14 Cb 1.07 -0.04 0.00 0.00 -0.56 0.00 0.00 39.33 39.80 2fex h ASP 14 CO 1.17 0.27 0.00 -2.67 -1.57 0.00 0.00 179.24 176.43 2fex n TRP 15 N -4.78 0.03 0.06 4.55 2.14 -1.26 -3.80 117.44 114.38 2fex n TRP 15 Ca 0.23 0.01 -0.21 0.00 2.07 0.00 0.00 57.50 59.60 2fex n TRP 15 Cb 0.58 -0.51 -0.15 0.00 -0.81 0.00 0.00 31.31 30.41 2fex n TRP 15 CO 0.00 0.00 0.00 0.93 2.07 0.00 0.00 177.69 180.69 2fex h GLU 16 N 0.00 0.34 -0.02 -2.67 5.08 -1.56 -3.35 114.58 112.40 2fex h GLU 16 Ca 0.00 -0.57 0.00 0.00 -1.00 0.00 0.00 59.36 57.79 2fex h GLU 16 Cb 0.41 0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.87 2fex h GLU 16 CO 0.00 1.27 -0.22 -0.35 -1.00 0.00 0.00 179.01 178.72 2fex n PRO 17 N -4.02 1.57 0.18 2.33 -0.04 -1.26 -4.71 135.00 129.05 2fex n PRO 17 Ca -0.16 -1.20 -0.14 0.00 -0.04 0.00 0.00 63.50 61.96 2fex n PRO 17 Cb 0.89 -1.48 -0.08 0.00 -0.04 0.00 0.00 33.50 32.79 2fex n PRO 17 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2fex h ALA 18 N 4.18 -0.46 -0.41 0.55 0.00 -1.70 -0.11 119.26 121.32 2fex h ALA 18 Ca 0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 2fex h ALA 18 Cb 0.75 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 2fex h ALA 18 CO 0.00 -0.62 0.13 1.25 0.00 0.00 0.00 179.25 180.01 2fex h LEU 19 N -0.73 0.59 -0.19 0.00 5.85 -1.84 -1.00 115.31 117.99 2fex h LEU 19 Ca -0.05 -0.20 0.03 0.00 0.84 0.00 0.00 57.88 58.50 2fex h LEU 19 Cb 0.50 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 2fex h LEU 19 CO 0.08 0.64 -0.01 0.25 -0.34 0.00 0.00 178.44 179.06 2fex h LEU 20 N 0.52 -0.09 -0.03 2.25 5.85 -1.85 -0.43 115.31 121.52 2fex h LEU 20 Ca 0.13 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 2fex h LEU 20 Cb 0.26 0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.37 2fex h LEU 20 CO -0.00 -0.02 0.00 0.00 -0.34 0.00 0.00 178.44 178.08 2fex h ALA 21 N 1.17 0.04 -0.40 1.25 0.00 -0.88 -0.88 119.26 119.56 2fex h ALA 21 Ca 0.09 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2fex h ALA 21 Cb 0.12 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2fex h ALA 21 CO -0.16 -0.31 0.24 0.00 0.00 0.00 0.00 179.25 179.03 2fex h ALA 22 N 0.73 0.52 -0.20 0.00 0.00 -1.13 -1.22 119.26 117.95 2fex h ALA 22 Ca 0.01 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2fex h ALA 22 Cb 0.29 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2fex h ALA 22 CO 0.00 0.01 0.02 0.00 0.00 0.00 0.00 179.25 179.28 2fex h ALA 23 N 1.11 0.27 -0.06 0.00 0.00 -1.03 -1.63 119.26 117.91 2fex h ALA 23 Ca 0.14 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.88 2fex h ALA 23 Cb 0.01 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2fex h ALA 23 CO -0.03 -0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.19 2fex h ALA 24 N 0.81 0.05 0.01 0.00 0.00 -1.11 -1.40 119.26 117.62 2fex h ALA 24 Ca 0.06 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2fex h ALA 24 Cb 0.35 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2fex h ALA 24 CO 0.01 -0.47 -0.00 -0.09 0.00 0.00 0.00 179.25 178.69 2fex h ARG 25 N 0.03 -0.01 0.09 0.00 2.43 -1.24 0.47 114.38 116.14 2fex h ARG 25 Ca 0.03 0.00 -0.30 0.00 -0.81 0.00 0.00 59.98 58.90 2fex h ARG 25 Cb 0.03 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 2fex h ARG 25 CO -0.04 0.70 -1.53 0.77 -1.51 0.00 0.00 179.97 178.36 2fex h SER 26 N -0.75 0.28 0.00 -3.80 0.02 -1.38 -3.23 113.55 104.69 2fex h SER 26 Ca -0.00 -0.41 -0.35 0.00 -0.84 0.00 0.00 61.79 60.18 2fex h SER 26 Cb 0.72 -0.09 -0.07 0.00 0.14 0.00 0.00 62.40 63.10 2fex h SER 26 CO 0.00 1.35 -2.34 -1.22 -1.14 0.00 0.00 176.83 173.48 2fex n TYR 27 N -3.38 0.00 0.39 3.45 4.01 -0.60 -4.64 117.16 116.40 2fex n TYR 27 Ca -0.15 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.65 2fex n TYR 27 Cb 1.03 -0.94 0.08 0.00 -0.31 0.00 0.00 39.34 39.20 2fex n TYR 27 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2fex n LEU 28 N -2.90 2.27 -1.10 7.72 4.77 -0.80 -5.00 117.00 121.96 2fex n LEU 28 Ca -0.36 -1.20 -0.13 0.00 -0.03 0.00 0.00 56.01 54.29 2fex n LEU 28 Cb 1.06 -0.05 -0.04 0.00 -2.33 0.00 0.00 43.42 42.05 2fex n LEU 28 CO 0.34 0.46 -0.13 0.61 -1.33 0.00 0.00 177.39 177.34 2fex n GLY 29 N 0.71 0.96 3.78 -0.72 0.00 -0.68 -4.94 105.19 104.30 2fex n GLY 29 Ca 0.09 -0.41 -0.37 0.00 0.00 0.00 0.00 46.02 45.33 2fex n GLY 29 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fex s VAL 30 N -2.52 4.12 -0.02 1.61 1.01 0.07 -4.75 120.40 119.93 2fex s VAL 30 Ca 0.00 1.73 -0.21 0.00 0.00 0.00 0.00 61.98 63.50 2fex s VAL 30 Cb 0.00 -3.94 -0.05 0.00 0.00 0.00 0.00 36.38 32.38 2fex s VAL 30 CO 0.00 0.11 0.62 -0.70 0.00 0.00 0.00 175.10 175.13 2fex s GLU 31 N -2.14 4.35 -0.16 2.72 2.12 -0.41 -4.03 118.70 121.15 2fex s GLU 31 Ca 0.52 0.76 -0.03 0.00 0.36 0.00 0.00 54.97 56.58 2fex s GLU 31 Cb -0.19 -3.36 -0.02 0.00 0.26 0.00 0.00 34.13 30.81 2fex s GLU 31 CO 0.24 0.30 -0.05 0.42 -0.54 0.00 0.00 175.26 175.64 2fex s ILE 32 N 0.02 3.67 -0.27 -3.70 -1.09 -1.26 -0.86 121.20 117.71 2fex s ILE 32 Ca 0.32 -0.43 -0.05 0.00 -2.23 0.00 0.00 60.65 58.26 2fex s ILE 32 Cb -0.18 -2.61 0.01 0.00 -1.58 0.00 0.00 42.46 38.10 2fex s ILE 32 CO 0.17 0.48 0.03 -0.69 -1.23 0.00 0.00 174.94 173.71 2fex s VAL 33 N 0.55 3.69 -0.13 2.92 1.01 -0.27 -4.97 120.40 123.20 2fex s VAL 33 Ca -0.04 -0.68 -0.14 0.00 0.00 0.00 0.00 61.98 61.12 2fex s VAL 33 Cb -0.15 -2.85 -0.05 0.00 0.00 0.00 0.00 36.38 33.34 2fex s VAL 33 CO 0.03 0.18 0.32 -1.00 0.00 0.00 0.00 175.10 174.63 2fex s HIS 34 N 1.47 3.51 0.15 5.22 3.76 -1.26 -0.64 115.29 127.51 2fex s HIS 34 Ca 0.03 0.68 0.08 0.00 -0.15 0.00 0.00 55.06 55.69 2fex s HIS 34 Cb -0.16 -2.34 -0.04 0.00 1.11 0.00 0.00 32.58 31.15 2fex s HIS 34 CO 0.00 0.31 -0.17 0.00 -0.85 0.00 0.00 174.74 174.03 2fex s ALA 35 N 0.20 1.84 0.15 -1.40 0.00 -0.34 -0.13 121.76 122.08 2fex s ALA 35 Ca 0.18 -1.43 0.06 0.00 0.00 0.00 0.00 51.96 50.78 2fex s ALA 35 Cb -0.14 -0.15 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 2fex s ALA 35 CO 0.06 0.19 -0.13 0.95 0.00 0.00 0.00 175.76 176.83 2fex s THR 36 N -2.08 1.36 0.26 0.00 -4.23 -0.82 -0.28 115.64 109.85 2fex s THR 36 Ca 0.14 -1.96 -0.02 0.00 -1.18 0.00 0.00 61.69 58.66 2fex s THR 36 Cb -0.05 -1.76 0.25 0.00 1.34 0.00 0.00 72.50 72.28 2fex s THR 36 CO 0.05 -0.58 1.69 -0.65 -0.54 0.00 0.00 174.62 174.59 2fex h PRO 37 N 3.03 0.30 -0.25 3.99 0.11 -1.90 -1.55 132.00 135.73 2fex h PRO 37 Ca -0.38 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.71 2fex h PRO 37 Cb 1.20 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2fex h PRO 37 CO 0.58 0.20 0.00 -0.40 -0.21 0.00 0.00 178.00 178.17 2fex n ASP 38 N -5.13 2.81 -1.76 -2.05 5.68 -1.26 -3.80 116.55 111.04 2fex n ASP 38 Ca 0.16 -1.83 -0.03 0.00 -0.50 0.00 0.00 54.79 52.60 2fex n ASP 38 Cb 0.52 -0.16 0.02 0.00 -1.14 0.00 0.00 41.12 40.35 2fex n ASP 38 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2fex n GLY 39 N 0.94 0.42 3.88 6.12 0.00 -0.64 -4.84 105.19 111.05 2fex n GLY 39 Ca 0.13 -0.17 -0.31 0.00 0.00 0.00 0.00 46.02 45.66 2fex n GLY 39 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2fex s PRO 41 N -3.59 3.80 0.21 1.61 0.02 -1.26 -4.73 135.00 131.05 2fex s PRO 41 Ca 0.07 0.35 0.04 0.00 0.02 0.00 0.00 61.00 61.48 2fex s PRO 41 Cb -0.01 -2.54 -0.05 0.00 0.02 0.00 0.00 34.50 31.93 2fex s PRO 41 CO 0.16 0.17 -0.03 0.14 -0.33 0.00 0.00 177.00 177.11 2fex s VAL 42 N -2.05 1.09 -0.14 3.83 -7.23 -0.40 -4.97 120.40 110.52 2fex s VAL 42 Ca 0.49 -2.05 0.02 0.00 -1.81 0.00 0.00 61.98 58.63 2fex s VAL 42 Cb -0.11 -2.20 0.00 0.00 0.56 0.00 0.00 36.38 34.64 2fex s VAL 42 CO 0.25 -0.45 -0.20 -0.89 -0.31 0.00 0.00 175.10 173.50 2fex s THR 43 N -3.38 2.28 0.00 5.32 2.01 -1.26 -0.15 115.64 120.46 2fex s THR 43 Ca 0.25 -0.91 0.00 0.00 0.31 0.00 0.00 61.69 61.34 2fex s THR 43 Cb 0.05 -1.92 0.00 0.00 0.01 0.00 0.00 72.50 70.63 2fex s THR 43 CO 0.06 0.54 0.00 -1.54 -0.69 0.00 0.00 174.62 172.99 2fex n SER 44 N 3.98 0.00 0.00 3.53 3.41 0.25 -0.12 113.62 124.67 2fex n SER 44 Ca -0.20 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.41 2fex n SER 44 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 2fex n SER 44 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fex n GLY 46 N 2.34 0.00 0.03 5.00 0.00 -1.26 -4.27 105.19 107.03 2fex n GLY 46 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2fex n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fex n GLY 47 N 0.00 0.53 3.68 -0.02 0.00 -1.26 -5.06 105.19 103.06 2fex n GLY 47 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2fex n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fex s LEU 48 N 0.00 4.35 -0.56 0.99 1.43 -1.26 -4.95 118.68 118.68 2fex s LEU 48 Ca 0.00 2.39 -0.21 0.00 -1.03 0.00 0.00 54.13 55.28 2fex s LEU 48 Cb 0.00 -3.55 0.06 0.00 0.03 0.00 0.00 46.19 42.74 2fex s LEU 48 CO 0.00 -0.91 0.78 -0.75 0.23 0.00 0.00 176.35 175.70 2fex s LYS 49 N 3.31 3.16 -0.22 1.70 2.47 -1.26 -0.58 119.74 128.32 2fex s LYS 49 Ca 0.74 -0.80 -0.09 0.00 -1.56 0.00 0.00 55.97 54.27 2fex s LYS 49 Cb -0.37 -4.14 -0.04 0.00 -1.46 0.00 0.00 37.83 31.81 2fex s LYS 49 CO 0.32 -1.46 0.10 0.08 0.16 0.00 0.00 175.35 174.56 2fex s VAL 50 N 3.24 4.96 -0.34 4.02 1.01 0.79 -4.96 120.40 129.11 2fex s VAL 50 Ca 0.19 0.04 -0.17 0.00 0.00 0.00 0.00 61.98 62.05 2fex s VAL 50 Cb -0.18 -3.28 -0.01 0.00 0.00 0.00 0.00 36.38 32.91 2fex s VAL 50 CO 0.12 0.40 0.43 -0.89 0.00 0.00 0.00 175.10 175.16 2fex s THR 51 N 0.83 5.10 0.95 3.92 2.01 -1.26 -1.28 115.64 125.91 2fex s THR 51 Ca 0.05 0.20 -0.15 0.00 0.31 0.00 0.00 61.69 62.10 2fex s THR 51 Cb -0.13 -3.88 0.17 0.00 0.01 0.00 0.00 72.50 68.67 2fex s THR 51 CO 0.02 -0.14 1.22 -2.16 -0.69 0.00 0.00 174.62 172.87 2fex s PRO 52 N 2.19 0.76 0.10 4.92 0.04 -1.26 -5.00 135.00 136.75 2fex s PRO 52 Ca 0.15 -0.08 -0.06 0.00 0.04 0.00 0.00 61.00 61.05 2fex s PRO 52 Cb -0.16 -1.83 -0.18 0.00 0.04 0.00 0.00 34.50 32.37 2fex s PRO 52 CO 0.12 -2.38 1.22 -0.44 0.04 0.00 0.00 177.00 175.56 2fex h ASP 53 N -1.63 0.57 -2.44 6.66 3.32 -0.90 -3.49 116.42 118.52 2fex h ASP 53 Ca -0.46 -0.51 -0.01 0.00 0.02 0.00 0.00 57.03 56.06 2fex h ASP 53 Cb 1.29 -0.18 0.01 0.00 0.22 0.00 0.00 39.33 40.66 2fex h ASP 53 CO 0.49 1.33 0.22 1.07 -1.72 0.00 0.00 179.24 180.63 2fex n THR 54 N -3.70 0.00 -3.64 0.35 5.66 -1.04 -5.04 114.28 106.88 2fex n THR 54 Ca -0.08 -0.71 -0.20 0.00 -3.05 0.00 0.00 64.05 60.00 2fex n THR 54 Cb 0.91 0.72 -0.02 0.00 -1.55 0.00 0.00 70.33 70.40 2fex n THR 54 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2fex s SER 55 N -2.54 5.58 0.16 1.09 1.04 -1.26 -1.94 113.70 115.83 2fex s SER 55 Ca 0.12 -0.37 -0.15 0.00 0.48 0.00 0.00 55.95 56.03 2fex s SER 55 Cb -0.04 -1.06 0.07 0.00 0.10 0.00 0.00 66.02 65.09 2fex s SER 55 CO 0.09 -0.41 1.79 1.88 0.98 0.00 0.00 173.24 177.57 2fex h TYR 56 N 1.07 0.43 -0.53 5.02 -1.99 -1.49 -2.37 116.97 117.11 2fex h TYR 56 Ca -0.45 0.02 0.07 0.00 2.00 0.00 0.00 58.73 60.36 2fex h TYR 56 Cb 1.26 -0.13 -0.03 0.00 2.00 0.00 0.00 36.73 39.82 2fex h TYR 56 CO 0.48 0.23 0.36 -0.44 -0.00 0.00 0.00 178.16 178.79 2fex h ASP 57 N 0.47 0.40 1.36 3.88 3.32 -1.88 -2.53 116.42 121.43 2fex h ASP 57 Ca 0.18 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.23 2fex h ASP 57 Cb 0.06 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.52 2fex h ASP 57 CO -0.11 0.26 0.00 0.00 -1.72 0.00 0.00 179.24 177.67 2fex n ALA 58 N -2.50 2.25 -1.99 3.45 0.00 -0.90 -4.82 120.51 115.99 2fex n ALA 58 Ca 0.08 -0.03 -0.42 0.00 0.00 0.00 0.00 53.44 53.07 2fex n ALA 58 Cb 0.27 -1.46 -0.03 0.00 0.00 0.00 0.00 19.45 18.23 2fex n ALA 58 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2fex s LEU 59 N -4.30 4.35 -0.21 0.00 1.43 -0.95 -4.98 118.68 114.01 2fex s LEU 59 Ca 0.11 2.36 0.01 0.00 -1.03 0.00 0.00 54.13 55.58 2fex s LEU 59 Cb 0.13 -3.55 0.04 0.00 0.03 0.00 0.00 46.19 42.84 2fex s LEU 59 CO 0.57 -0.88 -0.11 -0.62 0.23 0.00 0.00 176.35 175.54 2fex s ASP 60 N 2.70 3.59 0.00 2.29 -1.08 -1.26 -5.01 116.67 117.90 2fex s ASP 60 Ca 0.73 -0.97 0.03 0.00 -0.52 0.00 0.00 52.55 51.82 2fex s ASP 60 Cb -0.37 -1.32 0.14 0.00 -1.46 0.00 0.00 42.92 39.92 2fex s ASP 60 CO 0.31 -0.14 1.03 -0.81 0.52 0.00 0.00 175.17 176.08 2fex n PRO 61 N 4.63 0.02 -0.37 4.34 -0.04 -1.26 -3.26 135.00 139.06 2fex n PRO 61 Ca -0.15 0.37 0.05 0.00 -0.04 0.00 0.00 63.50 63.73 2fex n PRO 61 Cb 0.46 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.62 2fex n PRO 61 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 2fex h VAL 62 N 0.00 1.01 -0.03 0.52 3.04 -1.96 -2.96 116.25 115.87 2fex h VAL 62 Ca 0.00 -0.38 0.00 0.00 -1.01 0.00 0.00 66.70 65.31 2fex h VAL 62 Cb 0.04 -0.18 0.00 0.00 -2.01 0.00 0.00 31.29 29.14 2fex h VAL 62 CO 0.00 0.20 0.00 -0.90 -1.01 0.00 0.00 177.57 175.86 2fex n ASP 63 N -4.55 2.11 -4.11 3.17 5.75 -1.20 -4.98 116.55 112.73 2fex n ASP 63 Ca 0.17 -2.05 -0.31 0.00 -0.01 0.00 0.00 54.79 52.59 2fex n ASP 63 Cb 0.26 -0.04 -0.16 0.00 -1.03 0.00 0.00 41.12 40.15 2fex n ASP 63 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2fex s ILE 64 N -1.09 1.84 -0.28 2.12 1.01 -1.12 -4.56 121.20 119.14 2fex s ILE 64 Ca 0.04 -0.83 0.19 0.00 0.00 0.00 0.00 60.65 60.05 2fex s ILE 64 Cb 0.02 -1.66 0.15 0.00 0.01 0.00 0.00 42.46 40.98 2fex s ILE 64 CO 0.02 0.51 1.41 0.44 0.00 0.00 0.00 174.94 177.31 2fex h ASP 65 N 7.62 0.00 -5.01 3.58 3.32 -0.89 -3.44 116.42 121.60 2fex h ASP 65 Ca -0.36 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.62 2fex h ASP 65 Cb 1.17 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 40.54 2fex h ASP 65 CO 0.55 0.25 0.03 0.00 -1.72 0.00 0.00 179.24 178.36 2fex s ALA 66 N -3.10 -1.37 -0.17 3.45 0.00 -1.19 -3.39 121.76 115.98 2fex s ALA 66 Ca 0.04 0.77 0.01 0.00 0.00 0.00 0.00 51.96 52.78 2fex s ALA 66 Cb 0.07 0.22 0.01 0.00 0.00 0.00 0.00 23.12 23.42 2fex s ALA 66 CO 0.73 -0.43 -0.19 -1.17 0.00 0.00 0.00 175.76 174.70 2fex s LEU 67 N -1.63 2.19 -0.12 0.00 2.96 -0.38 -0.84 118.68 120.86 2fex s LEU 67 Ca -0.08 -0.61 0.03 0.00 -0.22 0.00 0.00 54.13 53.25 2fex s LEU 67 Cb -0.01 -1.49 0.01 0.00 0.50 0.00 0.00 46.19 45.20 2fex s LEU 67 CO 0.03 0.03 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.20 2fex s VAL 68 N 1.11 1.88 -0.30 1.68 1.01 0.59 -0.47 120.40 125.89 2fex s VAL 68 Ca 0.00 -0.88 0.03 0.00 0.00 0.00 0.00 61.98 61.13 2fex s VAL 68 Cb -0.14 -1.66 0.08 0.00 0.00 0.00 0.00 36.38 34.65 2fex s VAL 68 CO -0.08 0.52 -0.03 -0.63 0.00 0.00 0.00 175.10 174.88 2fex s ILE 69 N 0.74 2.13 0.64 2.22 1.01 0.11 -1.08 121.20 126.97 2fex s ILE 69 Ca -0.10 -1.91 -0.14 0.00 0.00 0.00 0.00 60.65 58.50 2fex s ILE 69 Cb -0.16 -2.41 -0.01 0.00 0.01 0.00 0.00 42.46 39.89 2fex s ILE 69 CO 0.01 -0.31 1.06 -2.16 0.00 0.00 0.00 174.94 173.54 2fex s PRO 70 N 1.05 3.10 0.00 2.79 0.04 -1.26 -2.12 135.00 138.59 2fex s PRO 70 Ca 0.01 1.11 0.00 0.00 0.04 0.00 0.00 61.00 62.16 2fex s PRO 70 Cb -0.19 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.34 2fex s PRO 70 CO -0.07 -0.98 0.00 0.41 0.04 0.00 0.00 177.00 176.40 2fex n GLY 71 N -1.36 -1.00 0.00 0.56 0.00 -1.00 -4.57 105.19 97.83 2fex n GLY 71 Ca 0.08 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.49 2fex n GLY 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fex n GLY 72 N 4.69 0.43 0.28 -0.02 0.00 -1.26 -1.35 105.19 107.96 2fex n GLY 72 Ca 0.00 -1.78 0.13 0.00 0.00 0.00 0.00 46.02 44.37 2fex n GLY 72 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2fex n LEU 73 N 0.00 1.13 0.18 0.99 4.77 -0.29 -4.23 117.00 119.55 2fex n LEU 73 Ca 0.00 -0.31 0.04 0.00 -0.03 0.00 0.00 56.01 55.71 2fex n LEU 73 Cb 0.00 -0.10 0.47 0.00 -2.33 0.00 0.00 43.42 41.45 2fex n LEU 73 CO 0.00 0.21 0.92 0.77 -1.33 0.00 0.00 177.39 177.96 2fex h SER 74 N 1.39 0.11 0.22 -1.43 4.64 -1.80 -1.77 113.55 114.91 2fex h SER 74 Ca 0.00 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.29 2fex h SER 74 Cb 0.52 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2fex h SER 74 CO 0.00 0.25 -0.11 -0.50 -0.87 0.00 0.00 176.83 175.61 2fex h TRP 75 N 0.11 -0.27 0.00 4.77 6.55 -1.89 0.40 115.95 125.62 2fex h TRP 75 Ca 0.02 -0.01 -0.01 0.00 0.95 0.00 0.00 58.89 59.84 2fex h TRP 75 Cb 0.30 0.09 -0.00 0.00 -0.86 0.00 0.00 29.16 28.68 2fex h TRP 75 CO 0.00 0.12 -0.07 1.05 -1.05 0.00 0.00 178.44 178.49 2fex h GLU 76 N -0.83 0.00 0.00 0.49 4.11 -1.81 0.88 114.58 117.42 2fex h GLU 76 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.40 2fex h GLU 76 Cb 0.51 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.76 2fex h GLU 76 CO 0.05 0.07 0.00 1.63 0.07 0.00 0.00 179.01 180.83 2fex n LYS 77 N -4.29 0.12 -0.74 1.06 5.02 -0.67 -4.91 118.16 113.75 2fex n LYS 77 Ca -0.03 0.24 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 2fex n LYS 77 Cb 0.15 -1.68 0.00 0.00 -0.02 0.00 0.00 35.03 33.48 2fex n LYS 77 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2fex n GLY 78 N 0.63 0.58 0.47 0.72 0.00 0.30 -4.96 105.19 102.94 2fex n GLY 78 Ca 0.04 -0.42 0.07 0.00 0.00 0.00 0.00 46.02 45.71 2fex n GLY 78 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2fex n THR 79 N -2.74 1.73 -1.99 2.61 -2.24 0.08 -5.03 114.28 106.70 2fex n THR 79 Ca 0.00 -2.44 -0.37 0.00 -2.27 0.00 0.00 64.05 58.98 2fex n THR 79 Cb 0.00 -0.08 0.03 0.00 -2.10 0.00 0.00 70.33 68.18 2fex n THR 79 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fex s ALA 80 N -2.58 2.67 0.48 6.98 0.00 -0.88 -4.84 121.76 123.59 2fex s ALA 80 Ca 0.33 1.08 -0.22 0.00 0.00 0.00 0.00 51.96 53.15 2fex s ALA 80 Cb 0.31 -3.47 -0.07 0.00 0.00 0.00 0.00 23.12 19.89 2fex s ALA 80 CO -0.04 -1.14 1.13 0.00 0.00 0.00 0.00 175.76 175.71 2fex s ALA 81 N -1.51 2.89 -0.10 0.00 0.00 -1.26 -5.00 121.76 116.78 2fex s ALA 81 Ca 0.74 0.85 -0.30 0.00 0.00 0.00 0.00 51.96 53.26 2fex s ALA 81 Cb -0.33 -3.35 -0.03 0.00 0.00 0.00 0.00 23.12 19.41 2fex s ALA 81 CO 0.37 -0.62 1.40 -0.51 0.00 0.00 0.00 175.76 176.40 2fex s ASP 82 N -1.55 6.85 -0.00 0.00 1.01 -1.26 -4.92 116.67 116.79 2fex s ASP 82 Ca 0.66 1.93 0.16 0.00 0.71 0.00 0.00 52.55 56.01 2fex s ASP 82 Cb -0.26 -2.54 -0.19 0.00 1.01 0.00 0.00 42.92 40.95 2fex s ASP 82 CO 0.30 -0.80 0.67 0.18 0.21 0.00 0.00 175.17 175.73 2fex n LEU 83 N 6.54 0.70 -0.11 1.23 4.77 -1.26 -4.72 117.00 124.16 2fex n LEU 83 Ca 0.15 -0.45 -0.07 0.00 -0.03 0.00 0.00 56.01 55.61 2fex n LEU 83 Cb 0.44 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.52 2fex n LEU 83 CO 0.58 0.17 0.65 1.23 -1.33 0.00 0.00 177.39 178.70 2fex h GLY 84 N 3.83 -0.20 0.97 -0.72 0.00 -1.91 0.39 103.07 105.43 2fex h GLY 84 Ca 0.00 0.38 -0.00 0.00 0.00 0.00 0.00 47.33 47.71 2fex h GLY 84 CO 0.00 -0.21 0.21 -1.33 0.00 0.00 0.00 176.54 175.21 2fex h GLY 85 N -0.24 0.54 0.85 4.60 0.00 -2.00 -1.24 103.07 105.57 2fex h GLY 85 Ca 0.17 -0.23 -0.04 0.00 0.00 0.00 0.00 47.33 47.22 2fex h GLY 85 CO -0.51 0.22 -0.01 -2.00 0.00 0.00 0.00 176.54 174.24 2fex h LEU 86 N 0.47 0.45 -0.48 3.11 5.85 -1.76 -0.49 115.31 122.46 2fex h LEU 86 Ca 0.13 -0.32 -0.02 0.00 0.84 0.00 0.00 57.88 58.50 2fex h LEU 86 Cb 0.03 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 2fex h LEU 86 CO -0.02 0.66 0.21 0.58 -0.34 0.00 0.00 178.44 179.53 2fex h VAL 87 N 0.23 1.20 -0.23 1.05 2.07 -0.84 -2.57 116.25 117.16 2fex h VAL 87 Ca 0.07 -0.59 -0.12 0.00 0.82 0.00 0.00 66.70 66.88 2fex h VAL 87 Cb 0.44 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 2fex h VAL 87 CO 0.02 0.23 -0.36 0.50 0.02 0.00 0.00 177.57 177.98 2fex h LYS 88 N 0.63 0.50 -0.94 1.57 1.63 -1.16 0.12 116.57 118.93 2fex h LYS 88 Ca 0.16 -0.23 0.07 0.00 -0.85 0.00 0.00 60.65 59.80 2fex h LYS 88 Cb 0.16 -0.01 -0.06 0.00 -0.60 0.00 0.00 32.23 31.72 2fex h LYS 88 CO -0.02 0.79 0.61 -0.09 -3.45 0.00 0.00 179.45 177.29 2fex h ARG 89 N 0.43 1.02 0.05 1.90 2.43 -0.79 0.32 114.38 119.74 2fex h ARG 89 Ca 0.05 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.08 2fex h ARG 89 Cb 0.82 -0.23 0.01 0.00 -0.42 0.00 0.00 29.97 30.15 2fex h ARG 89 CO 0.07 0.68 -0.34 0.74 -1.51 0.00 0.00 179.97 179.60 2fex h PHE 90 N 1.05 0.24 -0.23 2.20 -1.00 -1.02 -3.26 116.94 114.93 2fex h PHE 90 Ca 0.41 -0.17 -0.05 0.00 2.81 0.00 0.00 57.97 60.97 2fex h PHE 90 Cb 0.23 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 39.76 2fex h PHE 90 CO -0.00 1.10 -0.07 0.00 -1.61 0.00 0.00 178.31 177.73 2fex h ARG 91 N -0.69 0.35 0.00 1.51 3.08 -0.58 -1.18 114.38 116.87 2fex h ARG 91 Ca -0.06 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 59.90 2fex h ARG 91 Cb 1.24 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 31.23 2fex h ARG 91 CO 0.06 0.44 -0.08 -0.44 -1.07 0.00 0.00 179.97 178.88 2fex h ASP 92 N 0.34 0.00 -0.58 7.04 3.32 -0.44 -0.22 116.42 125.88 2fex h ASP 92 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 2fex h ASP 92 Cb 0.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.89 2fex h ASP 92 CO 0.02 0.08 0.00 0.54 -1.72 0.00 0.00 179.24 178.16 2fex n ARG 93 N -4.12 3.75 -2.39 3.56 5.12 -0.74 -4.93 116.66 116.92 2fex n ARG 93 Ca -0.03 -2.69 -0.18 0.00 -1.93 0.00 0.00 57.85 53.03 2fex n ARG 93 Cb 0.17 -1.93 -0.00 0.00 -1.16 0.00 0.00 32.46 29.53 2fex n ARG 93 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2fex n ASP 94 N 0.93 -5.17 -4.81 0.55 8.00 -0.09 -4.99 116.55 110.97 2fex n ASP 94 Ca 0.24 -0.04 -0.38 0.00 0.71 0.00 0.00 54.79 55.32 2fex n ASP 94 Cb 0.89 -4.23 -0.06 0.00 -0.02 0.00 0.00 41.12 37.71 2fex n ASP 94 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2fex s ARG 95 N -4.94 4.16 0.20 -1.24 1.81 -0.52 -5.02 118.95 113.39 2fex s ARG 95 Ca 0.02 0.68 -0.32 0.00 -1.72 0.00 0.00 55.73 54.39 2fex s ARG 95 Cb -0.01 -3.24 -0.15 0.00 -0.45 0.00 0.00 34.95 31.10 2fex s ARG 95 CO 0.03 0.63 1.25 -0.11 -0.68 0.00 0.00 175.30 176.42 2fex n LEU 96 N 1.81 2.09 -4.15 2.53 7.94 -1.22 -4.21 117.00 121.80 2fex n LEU 96 Ca -0.11 1.14 -0.26 0.00 -1.11 0.00 0.00 56.01 55.68 2fex n LEU 96 Cb 0.51 -1.29 -0.16 0.00 0.53 0.00 0.00 43.42 43.01 2fex n LEU 96 CO 0.41 -1.01 -0.50 -0.69 -1.11 0.00 0.00 177.39 174.48 2fex s VAL 97 N -0.15 1.42 -0.03 1.96 1.01 -0.75 -1.25 120.40 122.62 2fex s VAL 97 Ca 0.71 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.97 2fex s VAL 97 Cb -0.78 -1.20 0.02 0.00 0.00 0.00 0.00 36.38 34.41 2fex s VAL 97 CO 0.51 0.41 -0.04 0.00 0.00 0.00 0.00 175.10 175.98 2fex s ALA 98 N -0.14 0.53 0.00 5.51 0.00 0.38 -1.31 121.76 126.73 2fex s ALA 98 Ca 0.00 -0.05 0.01 0.00 0.00 0.00 0.00 51.96 51.92 2fex s ALA 98 Cb -0.10 -0.31 -0.01 0.00 0.00 0.00 0.00 23.12 22.71 2fex s ALA 98 CO 0.01 0.01 -0.02 0.20 0.00 0.00 0.00 175.76 175.96 2fex s GLY 99 N 0.65 0.13 0.04 0.00 0.00 0.13 0.05 107.32 108.33 2fex s GLY 99 Ca -0.08 -0.18 0.07 0.00 0.00 0.00 0.00 44.72 44.53 2fex s GLY 99 CO -0.00 -0.18 -0.21 -1.50 0.00 0.00 0.00 173.10 171.21 2fex s ILE 100 N -0.31 1.65 0.00 0.90 2.07 -0.90 -2.59 121.20 122.02 2fex s ILE 100 Ca -0.02 -1.19 0.00 0.00 -1.41 0.00 0.00 60.65 58.03 2fex s ILE 100 Cb -0.02 -1.44 0.00 0.00 0.13 0.00 0.00 42.46 41.13 2fex s ILE 100 CO -0.00 0.21 0.00 0.00 -1.91 0.00 0.00 174.94 173.23 2fex h ALA 102 N -0.63 2.51 0.00 0.00 0.00 -1.90 0.07 119.26 119.31 2fex h ALA 102 Ca 0.00 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 2fex h ALA 102 Cb 0.00 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2fex h ALA 102 CO 0.00 -0.70 -0.42 0.00 0.00 0.00 0.00 179.25 178.13 2fex h ALA 103 N 1.70 1.15 -0.64 0.00 0.00 -1.53 -1.12 119.26 118.82 2fex h ALA 103 Ca 0.27 -0.38 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 2fex h ALA 103 Cb 1.09 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 2fex h ALA 103 CO -0.00 0.52 0.15 0.00 0.00 0.00 0.00 179.25 179.92 2fex h ALA 104 N 1.58 1.06 -0.28 0.00 0.00 -0.94 -0.59 119.26 120.09 2fex h ALA 104 Ca -0.00 -0.23 -0.13 0.00 0.00 0.00 0.00 54.91 54.54 2fex h ALA 104 Cb 0.82 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2fex h ALA 104 CO 0.05 0.62 -0.36 0.77 0.00 0.00 0.00 179.25 180.33 2fex h SER 105 N 0.96 0.67 -0.93 0.00 0.02 -1.42 -1.66 113.55 111.18 2fex h SER 105 Ca 0.20 -0.29 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 2fex h SER 105 Cb 0.35 -0.19 -0.05 0.00 0.14 0.00 0.00 62.40 62.65 2fex h SER 105 CO 0.00 0.97 0.60 0.00 -1.14 0.00 0.00 176.83 177.26 2fex h ALA 106 N 1.07 1.19 -0.61 3.77 0.00 -0.92 -1.97 119.26 121.78 2fex h ALA 106 Ca 0.05 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.90 2fex h ALA 106 Cb 0.87 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 2fex h ALA 106 CO 0.08 0.61 0.39 -0.07 0.00 0.00 0.00 179.25 180.25 2fex h LEU 107 N 1.27 0.66 -1.36 0.00 3.38 -0.67 -2.08 115.31 116.51 2fex h LEU 107 Ca 0.34 -0.01 0.17 0.00 0.09 0.00 0.00 57.88 58.47 2fex h LEU 107 Cb -0.11 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 40.41 2fex h LEU 107 CO -0.07 0.47 0.58 1.23 0.09 0.00 0.00 178.44 180.74 2fex h GLY 108 N 0.78 1.11 2.00 0.83 0.00 -0.61 -0.72 103.07 106.46 2fex h GLY 108 Ca 0.23 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.31 2fex h GLY 108 CO -0.07 0.03 0.00 -1.33 0.00 0.00 0.00 176.54 175.17 2fex h GLY 109 N 0.57 0.00 0.43 4.60 0.00 -0.70 -1.93 103.07 106.04 2fex h GLY 109 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.80 2fex h GLY 109 CO -0.21 0.00 -0.37 -1.30 0.00 0.00 0.00 176.54 174.66 2fex n THR 110 N -2.88 0.00 -0.26 4.70 -2.24 -0.28 -4.61 114.28 108.71 2fex n THR 110 Ca -0.01 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 2fex n THR 110 Cb 0.16 0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 2fex n THR 110 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fex n GLY 111 N 1.40 1.40 0.01 3.38 0.00 -0.73 -4.94 105.19 105.72 2fex n GLY 111 Ca 0.10 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.20 2fex n GLY 111 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2fex n VAL 112 N -2.00 0.81 0.74 1.61 0.24 -1.24 -2.00 118.33 116.49 2fex n VAL 112 Ca 0.00 0.20 0.12 0.00 -2.04 0.00 0.00 64.34 62.62 2fex n VAL 112 Cb 0.00 -0.92 0.19 0.00 -1.47 0.00 0.00 33.84 31.64 2fex n VAL 112 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2fex n LEU 113 N -1.58 3.05 0.19 1.34 4.77 -1.26 -4.45 117.00 119.07 2fex n LEU 113 Ca 0.04 -1.17 0.03 0.00 -0.03 0.00 0.00 56.01 54.88 2fex n LEU 113 Cb 0.21 -0.12 0.41 0.00 -2.33 0.00 0.00 43.42 41.59 2fex n LEU 113 CO 0.17 0.59 0.79 0.78 -1.33 0.00 0.00 177.39 178.39 2fex h ASN 114 N 4.35 0.01 0.00 -1.43 2.35 -1.74 -3.31 115.58 115.82 2fex h ASN 114 Ca 0.00 -0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 2fex h ASN 114 Cb 0.94 -0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.25 2fex h ASN 114 CO 0.00 0.31 -0.40 -0.90 -1.65 0.00 0.00 177.43 174.79 2fex n ASP 115 N -4.19 1.16 -4.10 5.81 5.75 -1.26 -4.46 116.55 115.25 2fex n ASP 115 Ca -0.02 -2.60 -0.16 0.00 -0.01 0.00 0.00 54.79 52.00 2fex n ASP 115 Cb 0.34 -0.33 -0.12 0.00 -1.03 0.00 0.00 41.12 39.98 2fex n ASP 115 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 2fex s VAL 116 N -1.39 0.80 0.36 2.12 -7.23 -1.25 -5.04 120.40 108.78 2fex s VAL 116 Ca 0.20 -1.12 -0.28 0.00 -1.81 0.00 0.00 61.98 58.98 2fex s VAL 116 Cb 0.19 -0.80 -0.12 0.00 0.56 0.00 0.00 36.38 36.21 2fex s VAL 116 CO -0.02 -0.27 1.35 0.00 -0.31 0.00 0.00 175.10 175.85 2fex n ALA 117 N 1.50 1.61 -3.83 1.32 0.00 -1.26 -4.80 120.51 115.05 2fex n ALA 117 Ca -0.21 0.35 -0.06 0.00 0.00 0.00 0.00 53.44 53.51 2fex n ALA 117 Cb 0.55 -2.30 -0.01 0.00 0.00 0.00 0.00 19.45 17.69 2fex n ALA 117 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 2fex s HIS 118 N -1.11 -0.09 0.00 0.00 -3.43 -1.03 -4.30 115.29 105.33 2fex s HIS 118 Ca 0.55 -0.38 0.00 0.00 -0.80 0.00 0.00 55.06 54.43 2fex s HIS 118 Cb -0.54 0.72 0.00 0.00 -1.43 0.00 0.00 32.58 31.34 2fex s HIS 118 CO 0.62 -1.19 0.00 -2.37 -2.00 0.00 0.00 174.74 169.80 2fex n THR 119 N -0.50 0.00 -3.66 -5.38 5.66 -1.26 -0.19 114.28 108.96 2fex n THR 119 Ca -0.05 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.95 2fex n THR 119 Cb 0.60 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.38 2fex n THR 119 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2fex n GLY 120 N 0.00 0.70 0.24 1.09 0.00 -1.26 -4.47 105.19 101.49 2fex n GLY 120 Ca 0.00 -0.79 -0.01 0.00 0.00 0.00 0.00 46.02 45.22 2fex n GLY 120 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2fex h ASN 121 N 0.00 0.42 -4.08 1.61 2.35 -1.80 -3.35 115.58 110.73 2fex h ASN 121 Ca 0.00 -0.12 0.14 0.00 -0.55 0.00 0.00 56.30 55.77 2fex h ASN 121 Cb 0.00 -0.11 -0.22 0.00 0.05 0.00 0.00 38.32 38.04 2fex h ASN 121 CO 0.00 0.61 0.64 0.00 -1.65 0.00 0.00 177.43 177.04 2fex s ALA 122 N -4.65 -1.97 0.30 -0.83 0.00 -1.26 -5.01 121.76 108.35 2fex s ALA 122 Ca -0.07 1.53 0.01 0.00 0.00 0.00 0.00 51.96 53.44 2fex s ALA 122 Cb 0.15 -0.53 0.48 0.00 0.00 0.00 0.00 23.12 23.22 2fex s ALA 122 CO 0.77 -0.42 1.85 1.25 0.00 0.00 0.00 175.76 179.21 2fex h LEU 123 N 2.29 0.67 -1.85 0.00 5.85 -1.98 -1.29 115.31 119.00 2fex h LEU 123 Ca -0.16 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.43 2fex h LEU 123 Cb 1.18 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 42.03 2fex h LEU 123 CO 0.28 0.68 -0.06 0.00 -0.34 0.00 0.00 178.44 179.01 2fex h ALA 124 N 1.41 1.87 -0.59 1.25 0.00 -1.98 -0.85 119.26 120.37 2fex h ALA 124 Ca 0.15 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2fex h ALA 124 Cb 0.29 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2fex h ALA 124 CO 0.00 0.10 0.17 1.03 0.00 0.00 0.00 179.25 180.55 2fex h SER 125 N 0.02 0.88 -0.13 0.00 0.87 -1.63 -2.82 113.55 110.75 2fex h SER 125 Ca 0.01 -0.22 -0.11 0.00 -1.23 0.00 0.00 61.79 60.24 2fex h SER 125 Cb 0.12 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.83 2fex h SER 125 CO 0.01 0.87 -0.26 0.45 -0.53 0.00 0.00 176.83 177.37 2fex h HIS 126 N 0.85 0.66 0.00 2.24 -0.00 -1.05 -2.78 115.15 115.07 2fex h HIS 126 Ca 0.19 -0.15 0.00 0.00 -0.00 0.00 0.00 60.37 60.41 2fex h HIS 126 Cb 0.32 -0.16 0.00 0.00 -0.00 0.00 0.00 27.41 27.57 2fex h HIS 126 CO 0.02 0.79 0.00 1.63 -0.00 0.00 0.00 177.93 180.37 2fex n LYS 127 N -4.11 0.19 0.02 2.45 5.02 -0.62 -2.46 118.16 118.66 2fex n LYS 127 Ca -0.00 0.16 0.09 0.00 -2.02 0.00 0.00 58.31 56.54 2fex n LYS 127 Cb 0.43 -1.50 0.40 0.00 -0.02 0.00 0.00 35.03 34.34 2fex n LYS 127 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2fex n ALA 128 N -1.29 1.83 -3.13 7.82 0.00 -1.05 -4.58 120.51 120.11 2fex n ALA 128 Ca 0.06 -0.04 -0.37 0.00 0.00 0.00 0.00 53.44 53.09 2fex n ALA 128 Cb 0.11 -1.31 -0.12 0.00 0.00 0.00 0.00 19.45 18.12 2fex n ALA 128 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2fex s TYR 129 N -3.04 3.13 0.45 0.00 2.02 -1.03 -5.00 117.35 113.88 2fex s TYR 129 Ca 0.08 -0.83 0.24 0.00 -0.37 0.00 0.00 57.07 56.20 2fex s TYR 129 Cb 0.12 -2.26 1.25 0.00 -0.40 0.00 0.00 41.96 40.67 2fex s TYR 129 CO 0.35 -0.52 1.81 -1.35 -1.57 0.00 0.00 175.55 174.27 2fex h PRO 130 N 8.25 0.25 0.00 -1.71 0.11 -1.88 -1.20 132.00 135.81 2fex h PRO 130 Ca -0.33 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.76 2fex h PRO 130 Cb 1.14 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2fex h PRO 130 CO 0.60 0.16 0.00 0.00 -0.21 0.00 0.00 178.00 178.55 2fex n ALA 131 N -2.58 2.29 -2.27 -0.75 0.00 -1.26 -4.79 120.51 111.15 2fex n ALA 131 Ca 0.23 -0.08 -0.42 0.00 0.00 0.00 0.00 53.44 53.17 2fex n ALA 131 Cb 0.93 -1.46 -0.03 0.00 0.00 0.00 0.00 19.45 18.89 2fex n ALA 131 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2fex s TYR 132 N -3.03 2.73 -0.07 0.00 5.04 -0.45 -4.56 117.35 117.01 2fex s TYR 132 Ca 0.13 0.80 0.13 0.00 -2.44 0.00 0.00 57.07 55.69 2fex s TYR 132 Cb 0.17 -3.64 0.25 0.00 0.35 0.00 0.00 41.96 39.09 2fex s TYR 132 CO 0.54 -2.37 1.11 0.54 -1.34 0.00 0.00 175.55 174.03 2fex n ARG 133 N 6.00 0.56 -0.69 4.97 1.74 -1.26 -4.87 116.66 123.10 2fex n ARG 133 Ca 0.14 -2.01 0.07 0.00 -0.77 0.00 0.00 57.85 55.27 2fex n ARG 133 Cb 0.44 -0.79 0.33 0.00 -1.02 0.00 0.00 32.46 31.42 2fex n ARG 133 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2fex n GLY 134 N -0.39 2.63 0.37 -0.13 0.00 -1.26 -4.65 105.19 101.75 2fex n GLY 134 Ca 0.08 -0.76 0.15 0.00 0.00 0.00 0.00 46.02 45.49 2fex n GLY 134 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2fex h GLU 135 N 3.42 0.39 -0.09 1.61 9.09 -1.89 0.81 114.58 127.92 2fex h GLU 135 Ca 0.00 -0.02 0.03 0.00 0.05 0.00 0.00 59.36 59.41 2fex h GLU 135 Cb 1.61 -0.09 -0.00 0.00 -1.65 0.00 0.00 28.75 28.62 2fex h GLU 135 CO 0.35 0.26 0.10 0.00 0.05 0.00 0.00 179.01 179.77 2fex h ALA 136 N 1.66 1.68 -0.03 1.06 0.00 -1.94 -1.80 119.26 119.89 2fex h ALA 136 Ca 0.34 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2fex h ALA 136 Cb 0.78 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2fex h ALA 136 CO -0.10 -0.15 -0.07 0.72 0.00 0.00 0.00 179.25 179.66 2fex n HIS 137 N -3.85 0.00 -2.22 0.00 8.25 0.27 -4.96 115.22 112.71 2fex n HIS 137 Ca -0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.03 2fex n HIS 137 Cb 0.20 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.28 2fex n HIS 137 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 2fex s TYR 138 N -1.97 3.14 -0.28 4.41 5.04 -0.68 -2.47 117.35 124.54 2fex s TYR 138 Ca 0.25 0.95 -0.06 0.00 -2.44 0.00 0.00 57.07 55.77 2fex s TYR 138 Cb 0.19 -3.64 0.01 0.00 0.35 0.00 0.00 41.96 38.86 2fex s TYR 138 CO 0.32 -2.27 0.06 1.03 -1.34 0.00 0.00 175.55 173.35 2fex s ARG 139 N 1.52 3.13 -0.94 4.97 0.52 0.74 -4.95 118.95 123.93 2fex s ARG 139 Ca 0.64 -0.83 -0.21 0.00 -0.52 0.00 0.00 55.73 54.81 2fex s ARG 139 Cb -0.34 -3.31 0.09 0.00 0.52 0.00 0.00 34.95 31.91 2fex s ARG 139 CO 0.29 -0.41 1.25 0.34 0.02 0.00 0.00 175.30 176.79 2fex s ASP 140 N 1.49 6.54 0.05 0.23 2.15 -1.26 -4.53 116.67 121.35 2fex s ASP 140 Ca 0.03 -1.71 -0.08 0.00 0.43 0.00 0.00 52.55 51.22 2fex s ASP 140 Cb -0.17 -2.47 -0.00 0.00 -0.30 0.00 0.00 42.92 39.98 2fex s ASP 140 CO 0.02 -1.28 0.17 0.00 -0.17 0.00 0.00 175.17 173.90 2fex s GLN 141 N 3.75 0.72 0.27 4.34 -2.07 -1.26 -5.08 119.66 120.32 2fex s GLN 141 Ca 0.37 -0.77 0.06 0.00 -1.82 0.00 0.00 55.36 53.21 2fex s GLN 141 Cb -0.04 0.29 0.36 0.00 -1.09 0.00 0.00 33.01 32.53 2fex s GLN 141 CO -0.08 -0.21 1.63 -1.00 -1.32 0.00 0.00 175.29 174.31 2fex h PRO 142 N 3.26 0.21 -6.77 9.60 0.13 -1.99 -3.47 132.00 132.96 2fex h PRO 142 Ca -0.33 -0.12 -0.50 0.00 -0.87 0.00 0.00 66.00 64.18 2fex h PRO 142 Cb 1.19 0.01 0.01 0.00 0.13 0.00 0.00 31.00 32.34 2fex h PRO 142 CO 0.52 0.68 0.04 1.03 -0.23 0.00 0.00 178.00 180.04 2fex s ARG 143 N -3.91 3.66 0.65 0.86 0.52 -1.26 -4.66 118.95 114.82 2fex s ARG 143 Ca -0.04 0.25 -0.17 0.00 -0.52 0.00 0.00 55.73 55.25 2fex s ARG 143 Cb 0.13 -2.46 -0.04 0.00 0.52 0.00 0.00 34.95 33.10 2fex s ARG 143 CO 0.78 -0.02 0.74 0.00 0.02 0.00 0.00 175.30 176.82 2fex n ALA 144 N -1.52 -0.68 -2.42 2.13 0.00 -1.26 -4.89 120.51 111.87 2fex n ALA 144 Ca 0.01 -0.11 -0.32 0.00 0.00 0.00 0.00 53.44 53.02 2fex n ALA 144 Cb 0.54 -1.98 -0.14 0.00 0.00 0.00 0.00 19.45 17.88 2fex n ALA 144 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2fex s VAL 145 N -1.73 2.68 -0.09 0.00 1.01 0.52 -4.96 120.40 117.82 2fex s VAL 145 Ca 0.71 -1.00 -0.01 0.00 0.00 0.00 0.00 61.98 61.69 2fex s VAL 145 Cb -0.39 -2.05 0.03 0.00 0.00 0.00 0.00 36.38 33.97 2fex s VAL 145 CO 0.52 0.50 -0.04 -0.55 0.00 0.00 0.00 175.10 175.53 2fex s SER 146 N -0.95 1.86 -0.20 3.32 0.15 -1.26 -0.98 113.70 115.65 2fex s SER 146 Ca 0.12 -0.20 -0.14 0.00 0.70 0.00 0.00 55.95 56.44 2fex s SER 146 Cb -0.10 -0.65 0.06 0.00 -1.71 0.00 0.00 66.02 63.62 2fex s SER 146 CO 0.02 -0.15 0.51 -0.62 1.20 0.00 0.00 173.24 174.20 2fex s ASP 147 N 1.79 -0.62 -1.73 5.45 2.15 -0.62 -4.96 116.67 118.12 2fex s ASP 147 Ca 0.04 1.09 0.00 0.00 0.43 0.00 0.00 52.55 54.11 2fex s ASP 147 Cb -0.12 1.01 0.00 0.00 -0.30 0.00 0.00 42.92 43.50 2fex s ASP 147 CO -0.06 -0.20 0.00 0.61 -0.17 0.00 0.00 175.17 175.35 2fex n GLY 148 N 3.79 0.70 1.18 2.66 0.00 -1.26 -1.47 105.19 110.79 2fex n GLY 148 Ca -0.19 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.69 2fex n GLY 148 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fex n GLY 149 N -0.89 0.68 3.01 -0.02 0.00 -1.26 -5.05 105.19 101.66 2fex n GLY 149 Ca -0.20 -0.20 -0.27 0.00 0.00 0.00 0.00 46.02 45.35 2fex n GLY 149 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fex s VAL 150 N -2.00 1.26 -0.14 1.61 1.01 -0.54 -1.81 120.40 119.79 2fex s VAL 150 Ca 0.00 -0.51 -0.00 0.00 0.00 0.00 0.00 61.98 61.47 2fex s VAL 150 Cb 0.00 -1.17 -0.01 0.00 0.00 0.00 0.00 36.38 35.19 2fex s VAL 150 CO 0.00 0.39 -0.13 -0.69 0.00 0.00 0.00 175.10 174.68 2fex s VAL 151 N 1.00 3.05 0.12 2.92 1.01 -0.43 -1.59 120.40 126.48 2fex s VAL 151 Ca -0.07 -0.66 0.05 0.00 0.00 0.00 0.00 61.98 61.30 2fex s VAL 151 Cb -0.15 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 2fex s VAL 151 CO -0.01 0.52 -0.12 0.42 0.00 0.00 0.00 175.10 175.91 2fex s THR 152 N 0.45 1.22 0.09 3.92 -4.23 -0.15 -0.69 115.64 116.24 2fex s THR 152 Ca -0.09 -1.77 -0.26 0.00 -1.18 0.00 0.00 61.69 58.39 2fex s THR 152 Cb -0.16 -1.55 0.08 0.00 1.34 0.00 0.00 72.50 72.21 2fex s THR 152 CO 0.05 -0.51 0.70 0.00 -0.54 0.00 0.00 174.62 174.32 2fex s ALA 153 N -2.43 -1.69 0.61 3.99 0.00 -1.07 -0.35 121.76 120.82 2fex s ALA 153 Ca 0.10 0.74 -0.13 0.00 0.00 0.00 0.00 51.96 52.66 2fex s ALA 153 Cb -0.03 0.64 -0.04 0.00 0.00 0.00 0.00 23.12 23.69 2fex s ALA 153 CO 0.02 -0.70 1.03 0.00 0.00 0.00 0.00 175.76 176.11 2fex s ALA 154 N -3.30 2.91 0.22 0.00 0.00 -1.26 -0.42 121.76 119.92 2fex s ALA 154 Ca 0.01 0.11 0.34 0.00 0.00 0.00 0.00 51.96 52.42 2fex s ALA 154 Cb -0.01 -3.14 1.79 0.00 0.00 0.00 0.00 23.12 21.75 2fex s ALA 154 CO -0.10 -0.75 2.03 0.78 0.00 0.00 0.00 175.76 177.72 2fex h GLY 155 N 0.00 0.00 1.21 0.00 0.00 -1.88 -1.07 103.07 101.33 2fex h GLY 155 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 2fex h GLY 155 CO 0.60 0.00 -0.00 -1.14 0.00 0.00 0.00 176.54 175.99 2fex n SER 156 N -2.71 0.04 -2.47 0.19 3.41 -1.26 -4.28 113.62 106.54 2fex n SER 156 Ca -0.02 -0.63 -0.28 0.00 -0.26 0.00 0.00 58.87 57.68 2fex n SER 156 Cb 0.08 -0.12 0.01 0.00 -0.26 0.00 0.00 64.21 63.92 2fex n SER 156 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2fex n ALA 157 N -1.10 5.19 -0.02 7.33 0.00 -0.41 -4.87 120.51 126.63 2fex n ALA 157 Ca 0.19 -4.25 -0.00 0.00 0.00 0.00 0.00 53.44 49.38 2fex n ALA 157 Cb 0.18 -0.64 0.29 0.00 0.00 0.00 0.00 19.45 19.27 2fex n ALA 157 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2fex h PRO 158 N 2.57 0.57 -0.01 0.00 0.13 -1.79 -1.83 132.00 131.65 2fex h PRO 158 Ca 0.33 -0.12 -0.01 0.00 -0.87 0.00 0.00 66.00 65.34 2fex h PRO 158 Cb 0.91 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.95 2fex h PRO 158 CO 0.89 0.57 -0.02 0.28 -0.23 0.00 0.00 178.00 179.50 2fex h VAL 159 N 0.55 1.49 0.00 1.56 2.07 -1.93 -2.08 116.25 117.91 2fex h VAL 159 Ca 0.12 -1.45 -0.08 0.00 0.82 0.00 0.00 66.70 66.11 2fex h VAL 159 Cb 0.30 2.46 -0.01 0.00 -1.52 0.00 0.00 31.29 32.51 2fex h VAL 159 CO 0.01 0.38 -0.39 0.77 0.02 0.00 0.00 177.57 178.36 2fex h SER 160 N -0.58 0.00 -0.15 0.57 4.64 -1.96 -0.83 113.55 115.24 2fex h SER 160 Ca -0.00 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.35 2fex h SER 160 Cb 0.63 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.69 2fex h SER 160 CO 0.00 0.39 -0.05 0.15 -0.87 0.00 0.00 176.83 176.45 2fex h PHE 161 N 0.00 -0.11 -0.55 4.77 3.57 -1.30 -0.01 116.94 123.31 2fex h PHE 161 Ca -0.00 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 2fex h PHE 161 Cb 0.69 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.48 2fex h PHE 161 CO 0.00 -0.08 0.22 0.00 -2.23 0.00 0.00 178.31 176.22 2fex h ALA 162 N 1.12 0.71 -0.13 2.41 0.00 -0.66 -1.72 119.26 121.00 2fex h ALA 162 Ca 0.07 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.85 2fex h ALA 162 Cb 0.13 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2fex h ALA 162 CO -0.16 0.32 -0.03 0.28 0.00 0.00 0.00 179.25 179.65 2fex h VAL 163 N 0.74 0.87 -0.53 0.00 2.07 -0.92 -1.06 116.25 117.42 2fex h VAL 163 Ca 0.18 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.65 2fex h VAL 163 Cb 0.19 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 2fex h VAL 163 CO -0.02 0.00 0.12 -0.33 0.02 0.00 0.00 177.57 177.36 2fex h GLU 164 N -0.00 0.82 -0.12 1.57 4.39 -0.83 0.37 114.58 120.77 2fex h GLU 164 Ca 0.06 -0.17 -0.01 0.00 0.34 0.00 0.00 59.36 59.58 2fex h GLU 164 Cb 0.10 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 2fex h GLU 164 CO -0.13 0.75 0.03 0.82 -1.16 0.00 0.00 179.01 179.32 2fex h ILE 165 N 0.79 1.19 -0.72 3.13 2.04 -0.87 -1.30 117.51 121.77 2fex h ILE 165 Ca 0.17 -0.61 0.03 0.00 1.00 0.00 0.00 64.86 65.45 2fex h ILE 165 Cb 0.31 1.37 -0.04 0.00 -0.74 0.00 0.00 36.82 37.71 2fex h ILE 165 CO 0.00 0.18 0.46 -0.07 0.00 0.00 0.00 178.15 178.72 2fex h LEU 166 N -0.00 0.76 -0.53 1.44 3.38 -0.87 -1.89 115.31 117.60 2fex h LEU 166 Ca 0.04 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2fex h LEU 166 Cb 0.25 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2fex h LEU 166 CO 0.00 0.53 0.28 0.11 0.09 0.00 0.00 178.44 179.46 2fex h LYS 167 N 0.91 0.75 -0.34 1.13 1.57 -0.78 -0.82 116.57 118.99 2fex h LYS 167 Ca 0.29 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 2fex h LYS 167 Cb -0.00 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 2fex h LYS 167 CO -0.10 0.59 0.22 1.03 -0.57 0.00 0.00 179.45 180.61 2fex h SER 168 N 0.71 0.39 0.07 0.86 0.87 -0.82 -1.59 113.55 114.05 2fex h SER 168 Ca 0.19 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 2fex h SER 168 Cb 0.06 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 61.92 2fex h SER 168 CO -0.03 0.29 -0.04 0.18 -0.53 0.00 0.00 176.83 176.71 2fex n LEU 169 N -4.48 0.84 -1.95 2.23 4.77 -0.75 -4.92 117.00 112.75 2fex n LEU 169 Ca 0.02 -0.24 -0.15 0.00 -0.03 0.00 0.00 56.01 55.60 2fex n LEU 169 Cb 0.07 -0.04 0.01 0.00 -2.33 0.00 0.00 43.42 41.13 2fex n LEU 169 CO 0.35 0.14 -0.08 0.61 -1.33 0.00 0.00 177.39 177.09 2fex n GLY 170 N 1.15 -0.18 0.57 -0.72 0.00 -0.60 -4.93 105.19 100.48 2fex n GLY 170 Ca 0.19 -0.20 0.05 0.00 0.00 0.00 0.00 46.02 46.06 2fex n GLY 170 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2fex n LEU 171 N -2.54 2.68 -3.95 0.99 4.77 -0.36 -4.85 117.00 113.74 2fex n LEU 171 Ca -0.12 -1.80 -0.40 0.00 -0.03 0.00 0.00 56.01 53.67 2fex n LEU 171 Cb 0.60 -0.18 -0.02 0.00 -2.33 0.00 0.00 43.42 41.50 2fex n LEU 171 CO 0.27 0.65 0.82 0.33 -1.33 0.00 0.00 177.39 178.13 2fex n PHE 172 N 0.49 3.11 -1.97 -1.77 7.35 -1.22 -4.82 117.46 118.63 2fex n PHE 172 Ca 0.10 -3.21 -0.30 0.00 -0.76 0.00 0.00 57.45 53.29 2fex n PHE 172 Cb 0.39 -1.18 0.04 0.00 0.35 0.00 0.00 39.48 39.08 2fex n PHE 172 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 2fex s GLY 173 N -1.34 1.63 0.19 7.13 0.00 -1.26 -4.80 107.32 108.87 2fex s GLY 173 Ca 0.32 -0.38 0.04 0.00 0.00 0.00 0.00 44.72 44.70 2fex s GLY 173 CO 0.04 -0.03 0.92 -1.05 0.00 0.00 0.00 173.10 172.98 2fex n PRO 174 N -2.91 -0.04 -0.05 2.90 -0.01 -1.26 -0.54 135.00 133.08 2fex n PRO 174 Ca 0.06 0.86 -0.13 0.00 -0.01 0.00 0.00 63.50 64.29 2fex n PRO 174 Cb 0.57 -1.41 -0.07 0.00 -0.01 0.00 0.00 33.50 32.58 2fex n PRO 174 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 175.50 176.42 2fex h GLU 175 N 0.00 0.32 -0.47 -0.52 3.07 -1.98 -0.49 114.58 114.51 2fex h GLU 175 Ca 0.39 -0.17 -0.00 0.00 -0.50 0.00 0.00 59.36 59.08 2fex h GLU 175 Cb 0.86 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.75 2fex h GLU 175 CO -0.53 0.70 0.28 0.00 -1.40 0.00 0.00 179.01 178.07 2fex h ALA 176 N 0.61 1.61 -0.01 3.43 0.00 -1.54 -1.79 119.26 121.57 2fex h ALA 176 Ca 0.02 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2fex h ALA 176 Cb 0.64 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 2fex h ALA 176 CO 0.03 0.34 0.00 1.49 0.00 0.00 0.00 179.25 181.12 2fex h GLU 177 N 0.65 0.02 -0.55 0.00 4.81 -0.67 -2.01 114.58 116.82 2fex h GLU 177 Ca 0.17 -0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.42 2fex h GLU 177 Cb -0.02 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.32 2fex h GLU 177 CO -0.03 0.25 0.33 0.00 -0.73 0.00 0.00 179.01 178.83 2fex h ALA 178 N 0.77 0.71 -0.84 2.92 0.00 -0.86 -0.99 119.26 120.98 2fex h ALA 178 Ca 0.00 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.96 2fex h ALA 178 Cb 0.24 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.81 2fex h ALA 178 CO 0.00 0.05 0.52 0.93 0.00 0.00 0.00 179.25 180.75 2fex h GLU 179 N 0.66 0.93 0.00 0.00 4.39 -1.24 -2.78 114.58 116.54 2fex h GLU 179 Ca 0.22 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 59.85 2fex h GLU 179 Cb 0.03 -0.21 -0.00 0.00 -0.10 0.00 0.00 28.75 28.47 2fex h GLU 179 CO -0.10 0.61 -0.70 -0.07 -1.16 0.00 0.00 179.01 177.60 2fex h LEU 180 N 0.95 0.00 -1.75 1.33 3.38 -1.14 -3.30 115.31 114.78 2fex h LEU 180 Ca 0.36 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.30 2fex h LEU 180 Cb 0.16 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 2fex h LEU 180 CO -0.17 0.06 -0.14 -0.61 0.09 0.00 0.00 178.44 177.67 2fex h GLN 181 N 0.00 0.00 0.00 1.13 5.75 -0.89 -2.99 115.11 118.11 2fex h GLN 181 Ca -0.01 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 2fex h GLN 181 Cb 1.06 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.61 2fex h GLN 181 CO 0.01 0.14 0.00 0.97 -2.65 0.00 0.00 178.83 177.30 2fex h ILE 182 N 0.00 0.00 0.00 2.39 6.09 -1.63 -2.58 117.51 121.78 2fex h ILE 182 Ca -0.00 -0.27 0.00 0.00 -1.37 0.00 0.00 64.86 63.22 2fex h ILE 182 Cb 0.42 1.03 0.00 0.00 0.47 0.00 0.00 36.82 38.75 2fex h ILE 182 CO 0.02 0.00 0.00 0.49 -3.07 0.00 0.00 178.15 175.59 2fex n PHE 183 N -2.39 0.80 0.11 2.19 3.72 -1.13 -2.69 117.46 118.07 2fex n PHE 183 Ca 0.02 0.33 -0.03 0.00 -0.05 0.00 0.00 57.45 57.71 2fex n PHE 183 Cb 0.23 -1.03 0.07 0.00 -0.94 0.00 0.00 39.48 37.81 2fex n PHE 183 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2fex h ALA 184 N 2.22 0.74 -0.80 4.37 0.00 -1.70 -3.36 119.26 120.73 2fex h ALA 184 Ca 0.00 -0.68 0.06 0.00 0.00 0.00 0.00 54.91 54.28 2fex h ALA 184 Cb 0.31 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 2fex h ALA 184 CO 0.00 0.94 0.53 0.00 0.00 0.00 0.00 179.25 180.71 2fex h ALA 185 N 1.25 1.59 0.00 0.00 0.00 -1.72 -1.08 119.26 119.30 2fex h ALA 185 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2fex h ALA 185 Cb 1.34 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2fex h ALA 185 CO 0.10 0.30 0.00 -0.85 0.00 0.00 0.00 179.25 178.80 2fex n GLU 186 N -4.47 0.11 -0.16 0.00 0.28 -1.26 -2.14 120.64 113.00 2fex n GLU 186 Ca 0.12 0.31 0.12 0.00 -0.16 0.00 0.00 57.16 57.55 2fex n GLU 186 Cb 0.18 -1.70 0.22 0.00 1.43 0.00 0.00 31.44 31.57 2fex n GLU 186 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2fex n HIS 187 N -1.91 0.42 -0.40 -1.84 8.25 -0.41 -5.24 115.22 114.09 2fex n HIS 187 Ca 0.03 -0.21 0.00 0.00 -0.26 0.00 0.00 57.72 57.28 2fex n HIS 187 Cb 0.23 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.34 2fex n HIS 187 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85